Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2491524 | 0.81 | CA2 (0.40) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 | |
| SCHEMBL1707826 | 0.79 | LMNA (0.39) | SMN1; SMN2NPC1RAB9ACA2ALDH1A1 | |
| SCHEMBL21796427 | 0.79 | FLT1 (0.44) | MAPTFLT1FLT4KDRPTGS2 | |
| SCHEMBL28222876 | 0.78 | CA2 (0.36) | MAPTCYP2C9CA2 | |
| SCHEMBL4602235 | 0.78 | TAS1R3 (0.36) | NPC1RAB9ACA2ALDH1A1TSHR | |
| SCHEMBL13290725 | 0.78 | FLT1 (0.43) | MAPTSMN1; SMN2RAB9AFLT1FLT4 | |
| SCHEMBL27670058 | 0.78 | ALDH1A1 (0.45) | SMN1; SMN2CYP2C19NPC1CA2ALDH1A1 | |
| SCHEMBL29024319 | 0.77 | CA2 (0.36) | SMN1; SMN2CA2ALDH1A1TSHRHTT | |
| SCHEMBL28422404 | 0.77 | ALDH1A1 (0.44) | MAPTSMN1; SMN2RAB9AMCOLN3ALDH1A1 | |
| SCHEMBL29068583 | 0.76 | PTGS2 (0.40) | CYP1A2CYP2C19CYP2C9HPGDPTGS2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005021521-A1 | PREPARATION OF 1-[4-(2-METHOXY-PHENYL)-PIPERAZIN-1-YL]-3-(2,6-DIOXOPIPERIDIN-1-YL) PROPANE HYDROCHLORIDE | RANBAXY LABORATORIES LIMITED (IN) | 2005-03-10 | — | — | WO | disclosed |
| WO-1993019046-A1 | NOVEL SULFONAMIDE FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1993-09-30 | — | — | WO | disclosed |